| CAS Number | 499190-78-2 |
| Catalog Number | AG00I8WN(AGN-PC-0WR4I4) |
| Chemical Name | 1-{4-methoxy-3-[(morpholin-4-yl)methyl]phenyl}ethan-1-one |
| IUPAC Name | 1-[4-methoxy-3-(morpholin-4-ylmethyl)phenyl]ethanone |
| InChI | InChI=1S/C14H19NO3/c1-11(16)12-3-4-14(17-2)13(9-12)10-15-5-7-18-8-6-15/h3-4,9H,5-8,10H2,1-2H3 |
| InChI Key | KAPLNQBKFJMRTN-UHFFFAOYSA-N |
| MDL Number | MFCD00607779 |
| Molecular Formula | C14H19NO3 |
| Molecular Weight | 249.3056 |
| SMILES | COC1=C(CN2CCOCC2)C=C(C(C)=O)C=C1 |
| Synonyms | 1-[4-methoxy-3-(morpholin-4-ylmethyl)phenyl]ethanone,
499190-78-2,
1-[4-methoxy-3-(morpholin-4-ylmethyl)phenyl]ethan-1-one,
AC1LG6MX,
SCHEMBL334535,
AC1Q4C42,
CTK7A6216,
MFCD00607779,
ZINC19535117,
AKOS001082759,
MCULE-7678103486,
NE57375,
EN300-09600,
Z54748095,
1-{4-methoxy-3-[(morpholin-4-yl)methyl]phenyl}ethan-1-one,
CID789771,
|
| Complexity | 276 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 249.136g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 18 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 249.31g/mol |
| Monoisotopic Mass | 249.136g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 38.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number